SCHEMBL4188869

SCHEMBL4188869

Cc1cccc(Oc2ccc(C#N)c(Cl)c2)c1

nearest known ligand 0.67

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
AR P10275 9/20 0.67
ALDH1A1 P00352 1/20 0.50
L3MBTL1 Q9Y468 2/20 0.44
PGR P06401 1/20 0.44
HTT P42858 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
CYP19A1 P11511 1/20 0.43
SLC22A12 Q96S37 3/20 0.43
MRGPRX4 Q96LA9 1/20 0.43
TRPV4 Q9HBA0 1/20 0.42

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8543199 0.89 AR (0.62) ARALDH1A1PGRCYP19A1SLC22A12
SCHEMBL5503879 0.86 AR (0.62) ARALDH1A1L3MBTL1PGRSLC22A12
SCHEMBL30360746 0.85 AR (0.72) ARALDH1A1L3MBTL1HTTTDP1
SCHEMBL19231170 0.85 AR (0.72) ARALDH1A1L3MBTL1HTTTDP1
SCHEMBL4174837 0.84 AR (0.58) ARALDH1A1L3MBTL1PGRCYP19A1
SCHEMBL4184922 0.83 AR (0.65) ARALDH1A1PGRCYP19A1SLC22A12
SCHEMBL474005 0.82 AR (0.68) ARPGRSLC22A12TRPV4
SCHEMBL7073821 0.81 AR (0.55) ARALDH1A1PGRCYP19A1SLC22A12
SCHEMBL15096347 0.81 AR (0.66) ARALDH1A1L3MBTL1HTTTDP1
SCHEMBL27376756 0.81 AR (0.61) ARALDH1A1PGRCYP19A1SLC22A12

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090105349-A1 ANDROGEN MODULATORS WARNER-LAMBERT COMPANY LLC (US) 2009-04-23 US claimed
EP-1781280-A2 ANDROGEN MODULATORS Warner-Lambert Company LLC (US) 2007-05-09 EP claimed
WO-2006018723-A2 ANDROGEN MODULATORS WARNER-LAMBERT COMPANY LLC (US) 2006-02-23 WO claimed
US-20090105349-A1 ANDROGEN MODULATORS WARNER-LAMBERT COMPANY LLC (US) 2009-04-23 US disclosed
US-20090105349-A1 ANDROGEN MODULATORS WARNER-LAMBERT COMPANY LLC (US) 2009-04-23 US disclosed
US-20090105349-A1 ANDROGEN MODULATORS WARNER-LAMBERT COMPANY LLC (US) 2009-04-23 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090105349-A1 ANDROGEN MODULATORS AR, NR5A1, SHBG AR 1/4885ALDH1A1 1349/4885L3MBTL1 4790/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.